## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
B |
176 |
43 |
12282 |
◊ |
A |
x,y,z |
1_555 |
177 |
46 |
14409 |
1639.6 |
-13.6 |
0.390 |
24 |
7 |
0 |
0.629 |
2 |
|
D |
178 |
43 |
12280 |
◊ |
C |
x,y,z |
1_555 |
176 |
46 |
14413 |
1637.5 |
-13.4 |
0.402 |
23 |
7 |
0 |
0.629 |
Average: |
1638.5 |
-13.5 |
0.396 |
24 |
7 |
0 |
0.629 |
2 |
3 |
|
F |
43 |
7 |
1231 |
◊ |
C |
x,y,z |
1_555 |
60 |
24 |
14413 |
471.2 |
-3.8 |
0.424 |
5 |
0 |
0 |
0.135 |
4 |
|
E |
41 |
7 |
1225 |
◊ |
A |
x,y,z |
1_555 |
61 |
24 |
14409 |
468.2 |
-4.1 |
0.397 |
5 |
0 |
0 |
0.135 |
Average: |
469.7 |
-4.0 |
0.411 |
5 |
0 |
0 |
0.135 |
3 |
5 |
|
D |
50 |
15 |
12280 |
◊ |
A |
x,y,z |
1_555 |
41 |
12 |
14409 |
420.0 |
-3.8 |
0.440 |
2 |
2 |
0 |
0.000 |
6 |
|
B |
51 |
14 |
12282 |
◊ |
C |
x,y,z |
1_555 |
40 |
12 |
14413 |
415.2 |
-3.9 |
0.444 |
2 |
1 |
0 |
0.000 |
Average: |
417.6 |
-3.9 |
0.442 |
2 |
2 |
0 |
0.000 |
4 |
7 |
|
[ATP]C:381 |
30 |
1 |
601 |
f |
C |
x,y,z |
1_555 |
52 |
24 |
14413 |
419.0 |
-2.9 |
0.545 |
5 |
0 |
0 |
0.134 |
8 |
|
[ATP]A:381 |
30 |
1 |
597 |
f |
A |
x,y,z |
1_555 |
53 |
24 |
14409 |
413.3 |
-2.7 |
0.534 |
6 |
0 |
0 |
0.134 |
Average: |
416.1 |
-2.8 |
0.539 |
6 |
0 |
0 |
0.134 |
5 |
9 |
|
D |
35 |
9 |
12280 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
48 |
12 |
12282 |
344.7 |
-2.5 |
0.575 |
2 |
0 |
0 |
0.000 |
6 |
10 |
|
A |
38 |
12 |
14409 |
◊ |
D |
-x+1/2,y-1/2,-z |
3_545 |
38 |
9 |
12280 |
328.0 |
-1.1 |
0.566 |
3 |
3 |
0 |
0.000 |
11 |
|
B |
38 |
9 |
12282 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
3_546 |
38 |
12 |
14413 |
326.5 |
-1.3 |
0.562 |
2 |
3 |
0 |
0.000 |
Average: |
327.3 |
-1.2 |
0.564 |
3 |
3 |
0 |
0.000 |
7 |
12 |
|
D |
23 |
9 |
12280 |
◊ |
C |
x,y,z-1 |
1_554 |
22 |
8 |
14413 |
195.4 |
-2.6 |
0.357 |
0 |
0 |
0 |
0.000 |
13 |
|
A |
22 |
8 |
14409 |
◊ |
B |
x,y,z-1 |
1_554 |
23 |
9 |
12282 |
190.6 |
-2.3 |
0.388 |
0 |
0 |
0 |
0.000 |
Average: |
193.0 |
-2.5 |
0.372 |
0 |
0 |
0 |
0.000 |
8 |
14 |
|
C |
9 |
3 |
14413 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
14409 |
85.9 |
0.8 |
0.779 |
0 |
0 |
0 |
0.000 |
9 |
15 |
|
B |
10 |
4 |
12282 |
◊ |
C |
-x+1,-y+1,z |
2_665 |
15 |
7 |
14413 |
65.8 |
0.0 |
0.681 |
0 |
0 |
0 |
0.000 |
10 |
16 |
|
F |
3 |
1 |
1231 |
◊ |
D |
x,y,z |
1_555 |
6 |
4 |
12280 |
50.3 |
0.4 |
0.722 |
1 |
0 |
0 |
0.000 |
17 |
|
E |
3 |
1 |
1225 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
12282 |
48.6 |
0.4 |
0.720 |
1 |
0 |
0 |
0.000 |
Average: |
49.5 |
0.4 |
0.721 |
1 |
0 |
0 |
0.001 |
11 |
18 |
|
[MG]A:383 |
1 |
1 |
98 |
f |
[ATP]A:381 |
x,y,z |
1_555 |
7 |
1 |
597 |
37.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.139 |
19 |
|
[MG]C:383 |
1 |
1 |
98 |
f |
[ATP]C:381 |
x,y,z |
1_555 |
7 |
1 |
601 |
36.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.139 |
Average: |
36.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.139 |
12 |
20 |
|
[ATP]C:381 |
4 |
1 |
601 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
1231 |
36.5 |
0.5 |
0.618 |
1 |
0 |
0 |
0.000 |
21 |
|
[ATP]A:381 |
4 |
1 |
597 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
1225 |
35.3 |
0.4 |
0.607 |
1 |
0 |
0 |
0.000 |
Average: |
35.9 |
0.5 |
0.612 |
1 |
0 |
0 |
0.000 |
13 |
22 |
|
[MG]A:383 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
14409 |
31.5 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.104 |
23 |
|
[MG]C:383 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
14413 |
30.8 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.104 |
Average: |
31.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.104 |
14 |
24 |
|
[MG]A:383 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
1225 |
6.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.009 |
25 |
|
[MG]C:383 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
1231 |
5.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.009 |
Average: |
5.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.009 |
|